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arxiv: 2605.11590 · v1 · submitted 2026-05-12 · ❄️ cond-mat.str-el

Recognition: 1 theorem link

· Lean Theorem

Outstanding TC Enhancement in 5d-3d Y2NiIrO6 by Compression

Authors on Pith no claims yet

Pith reviewed 2026-05-13 01:21 UTC · model grok-4.3

classification ❄️ cond-mat.str-el
keywords Y2NiIrO6double perovskitepressure effectCurie temperaturesuperexchangeiridatesferrimagnetismMott insulator
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0 comments X

The pith

Physical pressure up to 17 GPa raises the Curie temperature of Y2NiIrO6 from 192 K to 240 K.

A machine-rendered reading of the paper's core claim, the machinery that carries it, and where it could break.

The paper investigates pressure effects on the double perovskite Y2NiIrO6 to clarify how superexchange produces magnetism in mixed 3d-5d compounds. It reports that pressures up to 17 GPa compress both the Ni/Ir-O bond lengths and the Ni-O-Ir bond angles at the same time. These structural changes raise the temperature of ferrimagnetic order. The rock-salt arrangement of Ni and Ir ions limits interactions to nearest neighbors only, so pressure does not create the frustration that appears in other iridates. This shows how a specific ordering can let lattice compression strengthen magnetism without the usual drawbacks.

Core claim

At ambient pressure Y2NiIrO6 is a ferrimagnetic insulator with an Ir4+ 5d Jeff = 1/2 Mott-insulating state. Under physical pressure up to 17 GPa the compound exhibits concurrent compression on Ni/Ir-O bond lengths and Ni-O-Ir bond angles, leading to increase of the Curie temperature from 192 to 240 K. In contrast to Sr2IrO4/Sr3Ir2O7, where pressure increases Ir-Ir distances and induces frustration from extended 5d orbitals, the rock-salt ordered Ni-Ir in YNIO blocks extended superexchange beyond nearest neighbors. The orthogonal Ni eg-Ir t2g pathway remains robust under lattice distortion, while superexchange weakens by bond bending in La2NiMnO6 with a similar configuration.

What carries the argument

The rock-salt ordered Ni-Ir arrangement that confines superexchange to nearest-neighbor paths and thereby suppresses pressure-induced magnetic frustration from extended 5d orbitals.

If this is right

  • Pressure can strengthen 5d-3d superexchange in ordered double perovskites without generating frustration.
  • The rock-salt Ni-Ir ordering supplies a structural motif that protects magnetic order under compression.
  • The Ni eg-Ir t2g exchange path tolerates lattice distortion better than the corresponding path in La2NiMnO6.
  • Bond engineering via pressure offers a route to higher Curie temperatures in iridate-related systems.

Where Pith is reading between the lines

These are editorial extensions of the paper, not claims the author makes directly.

  • Other 3d-5d double perovskites with rock-salt order may display similar pressure-driven TC gains if nearest-neighbor exchange dominates.
  • Direct computation of the pressure dependence of the exchange integral J would test whether the observed bond changes quantitatively account for the 48 K rise.
  • Disrupting the Ni-Ir order in related compounds should allow pressure to induce frustration and lower TC instead.

Load-bearing premise

The rise in Curie temperature is produced directly by the compression of Ni/Ir-O bonds and Ni-O-Ir angles rather than by other pressure-induced changes such as bandwidth shifts or defect creation.

What would settle it

A high-pressure measurement that finds the magnetic exchange coupling strength unchanged or reduced despite the reported bond-length and angle compression would falsify the causal link.

read the original abstract

Understanding and predicting the properties of 5d compounds critically depend on the identification of the superexchange interactions from which their magnetism emerges. The study of pressure effects on double perovskites Y2NiIrO6 (YNIO) provide deep insight toward this goal. At ambient pressure, YNIO is a ferrimagnetic insulator with the Ir4+-5d Jeff = 1/2 Mott-insulating state. Under the physical pressure up to 17 GPa, the compound exhibits concurrent compression on Ni/Ir-O bond lengths and Ni-O-Ir bond angles, leading to increase of the Curie temperature from 192 to 240 K. In contrary, external pressure increases distanced Ir-Ir interaction and in turn induces magnetic frustration in Sr2IrO4/Sr3Ir2O7 due to the extended 5d orbitals. In YNIO, the rock-salt ordered Ni-Ir naturally blocks extended superexchange beyond the nearest neighbor, and in turn suppresses such magnetic frustration. Moreover, the orthogonal Ni eg-Ir t2g pathway in YNIO is robust under lattice distortion, while the superexchange is weakened by bond bending in La2NiMnO6 with a similar half-filed eg-t2g configuration. Our findings establish a framework for elucidating the mechanism of 5d-3d superexchange and guides bond-engineered magnetism in iridate-related systems.

Editorial analysis

A structured set of objections, weighed in public.

Desk editor's note, referee report, simulated authors' rebuttal, and a circularity audit. Tearing a paper down is the easy half of reading it; the pith above is the substance, this is the friction.

Referee Report

3 major / 2 minor

Summary. The manuscript reports experimental results on the double perovskite Y2NiIrO6 (YNIO), a ferrimagnetic insulator at ambient pressure with Ir4+ Jeff=1/2 Mott state. Under hydrostatic pressure up to 17 GPa, it observes concurrent compression of Ni/Ir-O bond lengths and Ni-O-Ir bond angles, accompanied by an increase in Curie temperature from 192 K to 240 K. The authors attribute this TC enhancement to strengthened 5d-3d superexchange via the orthogonal Ni eg-Ir t2g pathway, arguing that rock-salt Ni-Ir ordering blocks extended superexchange paths and thereby suppresses the magnetic frustration seen under pressure in Sr2IrO4/Sr3Ir2O7; they contrast this with bond-bending weakening in La2NiMnO6.

Significance. If the causal attribution of the 48 K TC rise to the measured structural compressions holds after quantitative validation, the work would provide a useful experimental benchmark for 5d-3d superexchange mechanisms in iridates and a route to pressure- or strain-tuned higher-TC magnets. The contrast with frustration in other iridates is conceptually interesting and could guide bond-engineering strategies, though the current evidence remains largely correlative.

major comments (3)
  1. [Abstract/Results] Abstract and Results section: The central claim of a pressure-induced TC increase from 192 K to 240 K is load-bearing, yet the manuscript provides neither raw magnetization data, error bars on TC or bond lengths/angles, nor details on the protocol used to determine magnetic ordering (e.g., ZFC/FC susceptibility, specific-heat anomaly, or Arrott-plot analysis). Without these, the magnitude and robustness of the 48 K enhancement cannot be assessed.
  2. [Discussion] Discussion section: The mechanistic explanation that bond-length and angle compression directly accounts for the full TC rise via strengthened superexchange lacks any quantitative mapping (e.g., DFT-derived J values or Goodenough-Kanamori estimates applied to the measured distances/angles). Alternative pressure effects such as Ir 5d bandwidth broadening, possible valence shifts, or defect annealing are not experimentally excluded or bounded.
  3. [Discussion] Discussion section: The assertion that rock-salt Ni-Ir ordering 'fully' blocks extended superexchange paths and thereby eliminates frustration is stated without supporting calculation of longer-range exchange integrals or comparison to a disordered reference sample; this assumption is load-bearing for the claim that YNIO avoids the pressure-induced frustration of Sr2IrO4.
minor comments (2)
  1. [Abstract] Abstract: 'In contrary' is grammatically incorrect and should read 'In contrast'.
  2. [Results] The manuscript would benefit from a table summarizing the pressure dependence of lattice parameters, bond lengths, angles, and extracted TC values with uncertainties.

Simulated Author's Rebuttal

3 responses · 1 unresolved

We thank the referee for the careful and constructive review of our manuscript. We address each major comment below and indicate the revisions made to the manuscript.

read point-by-point responses
  1. Referee: [Abstract/Results] Abstract and Results section: The central claim of a pressure-induced TC increase from 192 K to 240 K is load-bearing, yet the manuscript provides neither raw magnetization data, error bars on TC or bond lengths/angles, nor details on the protocol used to determine magnetic ordering (e.g., ZFC/FC susceptibility, specific-heat anomaly, or Arrott-plot analysis). Without these, the magnitude and robustness of the 48 K enhancement cannot be assessed.

    Authors: We agree that these supporting details are essential for evaluating the central claim. The original submission emphasized the key trends but did not include the raw data or full protocol description. In the revised manuscript we have added the raw ZFC/FC magnetization curves under pressure to the supplementary information, included error bars on the extracted TC values and on the bond lengths/angles in the main figures, and expanded the methods section to specify that TC is determined from the bifurcation point in the susceptibility curves, cross-checked against specific-heat anomalies where measured. revision: yes

  2. Referee: [Discussion] Discussion section: The mechanistic explanation that bond-length and angle compression directly accounts for the full TC rise via strengthened superexchange lacks any quantitative mapping (e.g., DFT-derived J values or Goodenough-Kanamori estimates applied to the measured distances/angles). Alternative pressure effects such as Ir 5d bandwidth broadening, possible valence shifts, or defect annealing are not experimentally excluded or bounded.

    Authors: The manuscript's argument rests on the observed correlation between the measured structural compressions and the TC increase, together with the contrast to La2NiMnO6. We have revised the discussion to incorporate a semi-quantitative Goodenough-Kanamori estimate based on the compressed Ni-O-Ir distances and angles, showing an expected strengthening of the orthogonal eg-t2g superexchange. We have also added text bounding the alternatives: the system remains a Mott insulator under pressure, which limits the extent of 5d bandwidth broadening; valence shifts are inconsistent with the stable Ni2+/Ir4+ oxidation states; and defect annealing is not anticipated under hydrostatic compression. Full DFT-derived J values under pressure are not provided, as they lie outside the scope of the present experimental study. revision: partial

  3. Referee: [Discussion] Discussion section: The assertion that rock-salt Ni-Ir ordering 'fully' blocks extended superexchange paths and thereby eliminates frustration is stated without supporting calculation of longer-range exchange integrals or comparison to a disordered reference sample; this assumption is load-bearing for the claim that YNIO avoids the pressure-induced frustration of Sr2IrO4.

    Authors: We have revised the text to remove the absolute term 'fully' and to emphasize the geometric consequence of the rock-salt ordering: the Ni ions separate the Ir ions, eliminating the direct Ir-O-Ir nearest-neighbor pathways that exist in Sr2IrO4/Sr3Ir2O7. This structural distinction is directly visible in the diffraction data and does not require additional longer-range integral calculations for the nearest-neighbor-dominated regime. A disordered reference sample cannot be prepared, as the synthesis conditions yield only the ordered double-perovskite phase. The absence of pressure-induced frustration in YNIO is therefore inferred from the contrasting pressure response relative to the layered iridates. revision: partial

standing simulated objections not resolved
  • New DFT calculations of pressure-dependent exchange integrals J, which would require computational resources and expertise beyond the current experimental manuscript.

Circularity Check

0 steps flagged

No circularity: experimental observations of TC rise under pressure are measured independently of proposed structural mechanism

full rationale

The paper is an experimental study reporting direct measurements of lattice compression, bond lengths/angles, and Curie temperature under applied pressure up to 17 GPa. The central result (TC increasing from 192 K to 240 K) is obtained from independent magnetometry and diffraction experiments, not derived from any model, fit, or equation whose inputs include the same TC data. Interpretive discussion of superexchange pathways and comparisons to other compounds (La2NiMnO6, Sr2IrO4) is correlative and does not constitute a derivation chain that reduces to self-definition or fitted inputs. No equations, ansatzes, or self-citations are presented as load-bearing for the primary claim. The work is therefore self-contained against external benchmarks with no reduction of predictions to inputs by construction.

Axiom & Free-Parameter Ledger

0 free parameters · 2 axioms · 0 invented entities

The paper is experimental and reports measured TC values and inferred structural changes; it does not introduce new free parameters, axioms beyond standard condensed-matter assumptions, or invented entities.

axioms (2)
  • domain assumption Ir4+ adopts a Jeff = 1/2 Mott-insulating state at ambient pressure
    Stated in the abstract as the starting electronic configuration.
  • domain assumption Rock-salt Ni-Ir ordering blocks extended superexchange paths
    Invoked to explain absence of frustration under pressure.

pith-pipeline@v0.9.0 · 5624 in / 1420 out tokens · 33200 ms · 2026-05-13T01:21:56.248211+00:00 · methodology

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Reference graph

Works this paper leans on

43 extracted references · 43 canonical work pages

  1. [1]

    B. J. Kim, H. Ohsumi, T. Komesu, et al., Phase-Sensitive Observation of a Spin-Orbital Mott State in Sr2IrO4, Science 2009, 323, 1329

  2. [2]

    Takagi, T

    H. Takagi, T. Takayama, G. Jackeli, et al., Concept and realization of Kitaev quantum spin liquids, Nature Reviews Physics 2019, 1, 264

  3. [3]

    H. Kim, J. K. Kim, J. Kwon, et al., Quantum spin nematic phase in a square -lattice iridate, Nature 2024, 625, 264

  4. [4]

    S. G. Jeong, J. Y . Oh, L. Hao, et al., Correlated Quantum Phenomena of Spin-Orbit Coupled Perovskite Oxide Heterostructures: Cases of SrRuO3 and SrIrO3 Based Artificial Superlattices, Advanced Functional Materials 2023, 33, 2301770

  5. [5]

    G. Cao, P. Schlottmann, The challenge of spin-orbit-tuned ground states in iridates: a key issues review, Reports on Progress in Physics 2018, 81, 042502

  6. [6]

    Haskel, G

    D. Haskel, G. Fabbris, M. Zhernenkov, et al., Pressure Tuning of the Spin-Orbit Coupled Ground State in Sr2IrO4, Physical Review Letters 2012, 109, 027204

  7. [7]

    L. Li, P. P. Kong, T. F. Qi, et al., Tuning the Jeff=1/2 insulating state via electron doping and pressure in the double-layered iridate Sr3Ir2O7, Physical Review B 2013, 87, 235127

  8. [8]

    Matsuno, K

    J. Matsuno, K. Ihara, S. Yamamura, et al., Engineering a Spin-Orbital Magnetic Insulator by Tailoring Superlattices, Physical Review Letters 2015, 114, 247209

  9. [9]

    Nichols, X

    J. Nichols, X. Gao, S. Lee, et al., Emerging magnetism and anomalous Hall effect in iridate-manganite heterostructures, Nature Communications 2016, 7, 12721

  10. [10]

    X. X. Huang, S. Sayed, J. Mittelstaedt, et al., Novel Spin -Orbit Torque Generation at Room Temperature in an All -Oxide Epitaxial La 0.7Sr0.3MnO3/SrIrO3 System, Advanced Materials 2021, 33, 2008269

  11. [11]

    E. Men, D. Y . Li, H. Y . Zhang, et al., An atomically controlled insulator -to-metal transition in iridate/manganite heterostructures, Nature Communications 2024, 15, 8427

  12. [12]

    Zhang, Y

    C. Zhang, Y . Zhang, Z. Nie, et al., Double Perovskite La2MnNiO6 as a High-Performance Anode for Lithium-Ion Batteries, Advanced Science 2023, 10, 2300506

  13. [13]

    L. Jin, D. Ni, X. Gui, et al., Ferromagnetic Double Perovskite Semiconductors with Tunable Properties, Advanced Science 2022, 9, 2104319

  14. [14]

    Vasala, M

    S. Vasala, M. Karppinen, A2B'B''O6 perovskites: A review, Progress in Solid State Chemistry 2015, 43, 1

  15. [15]

    B. Yuan, S. Kim, S. H. Chun, et al., Robust long-range magnetic correlation across antiphase domain boundaries in Sr 2CrReO6, Physical Review B 2021, 103, 064410

  16. [16]

    Liang, M

    Z. Liang, M. Batuk, F. Orlandi, et al., Disproportionation of Co 2+ in the Topochemically Reduced Oxide LaSrCoRuO5, Angewandte Chemie International Edition 2024, 63, e202313067. 17

  17. [17]

    J. R. Soh, M. E. Merkel, L. V . Pourovskii, et al., Spectroscopic signatures and origin of hidden order in Ba2MgReO6, Nature Communications 2024, 15, 10383

  18. [18]

    Otsuka, R

    T. Otsuka, R. Oka, T. Hayakawa, Eu 3+ Site Distribution and Local Distortion of Photoluminescent Ca3WO6: (Eu3+, K+) Double Perovskites as High-Color-Purity Red Phosphors, Advanced Science 2023, 10, 2302559

  19. [19]

    Z. Deng, X. Wang, M. Wang, et al., Giant Exchange-Bias-Like Effect at Low Cooling Fields Induced by Pinned Magnetic Domains in Y2NiIrO6 Double Perovskite, Advanced Materials 2023, 35, 2209759

  20. [20]

    Nazir, A

    S. Nazir, A. A. Algethami, M. Musa Saad H. -E, Evolution of metallicity, enhancement of T C and magnetic anisotropy energy in Y 2NiIrO6: Hydrostatic ([111]) strain influence, Journal of Physics and Chemistry of Solids 2025, 197, 112410

  21. [21]

    S. S. Pandey, H. Zhang, J. Y . Yang, et al., Controllable Emergent Spatial Spin Modulation in Sr2IrO4 by In Situ Shear Strain, Physical Review Letters 2022, 129, 027203

  22. [22]

    H. L. Feng, Z. Deng, M. X. Wu, et al., High-Pressure Synthesis of Lu2NiIrO6 with Ferrimagnetism and Large Coercivity, Inorganic Chemistry 2019, 58, 397

  23. [23]

    P. C. Rout, U. Schwingenschlogl, Large Magnetocrystalline Anisotropy and Giant Coercivity in the Ferrimagnetic Double Perovskite Lu2NiIrO6, Nano Letters 2021, 21, 6807

  24. [24]

    B. H. Toby, EXPGUI, a graphical user interface for GSAS, Journal of Applied Crystallography 2001, 34, 210

  25. [25]

    N. Li, B. Manoun, L. Tang, et al., Pressure-Induced Structural and Electronic Transition in Sr2ZnWO6 Double Perovskite, Inorganic Chemistry 2016, 55, 6770

  26. [26]

    J. S. Zhou, J. Q. Yan, J. B. Goodenough, Bulk modulus anomaly in RCoO 3 (R=La, Pr, and Nd), Physical Review B 2005, 71, 220103(R)

  27. [27]

    Saeed, A

    U. Saeed, A. Islam, B. F. Felemban, et al., Electronic and magnetic phase transitions, optimized MAE/ TC, and high thermoelectric response in Y 2NiIrO6: Strain effects, Computational Materials Science 2025, 253, 113880

  28. [28]

    Morrow, K

    R. Morrow, K. Samanta, T. Saha Dasgupta, et al., Magnetism in Ca 2CoOsO6 and Ca 2NiOsO6: Unraveling the Mystery of Superexchange Interactions between 3d and 5d Ions, Chemistry of Materials 2016, 28, 3666

  29. [29]

    L. Liu, K. Yang, D. Lu, et al., Varying magnetism in the lattice distorted Y 2NiIrO6 and La2NiIrO6, Physical Review B 2023, 108, 174428

  30. [30]

    L. S. I. Veiga, G. Fabbris, M. van Veenendaal, et al., Fragility of ferromagnetic double exchange interactions and pressure tuning of magnetism in 3d- 5d double perovskite Sr2FeOsO6, Physical Review B 2015, 91, 235135

  31. [31]

    G. M. Gaifutdinov, I. V . Leonov, Electronic correlations and long- range magnetic ordering in NiO tuned by pressure, Physical Review B 2024, 110, 235103

  32. [32]

    Klotz, Neutron diffraction studies on “simple” iron oxides under pressure: Fe3O4, α-Fe2O3, and FeO, Chinese Science Bulletin 2014, 59, 5241

    S. Klotz, Neutron diffraction studies on “simple” iron oxides under pressure: Fe3O4, α-Fe2O3, and FeO, Chinese Science Bulletin 2014, 59, 5241

  33. [33]

    Haskel, G

    D. Haskel, G. Fabbris, J. H. Kim, et al., Possible Quantum Paramagnetism in Compressed Sr 2IrO4, Physical Review Letters 2020, 124, 067201

  34. [34]

    Zhang, D

    J. Zhang, D. Yan, S. Yesudhas, et al., Lattice frustration in spin- orbit Mott insulator Sr 3Ir2O7 at high 18 pressure, npj Quantum Materials 2019, 4, 23

  35. [35]

    Haskel, G

    D. Haskel, G. Fabbris, N. M. Souza -Neto, et al., Stability of the ferromagnetic ground state of La2MnNiO6 against large compressive stress, Physical Review B 2011, 84, 100403(R)

  36. [36]

    C. J. Ridley, D. Daisenberger, C. W. Wilson, et al., High-Pressure Study of the Elpasolite Perovskite La2NiMnO6, Inorgnic Chemistry 2019, 58, 9016

  37. [37]

    Ferreira, G

    T. Ferreira, G. Morrison, J. Yeon, et al., Design and Crystal Growth of Magnetic Double Perovskite Iridates: Ln2MIrO6 (Ln= La, Pr, Nd, Sm-Gd; M = Mg, Ni), Crystal Growth & Design 2016, 16, 2795

  38. [38]

    Kayser, A

    P. Kayser, A. Muñoz, J. L. Martínez, et al., Enhancing the Néel temperature in 3d/5d R2NiIrO6 (R=La, Pr and Nd) double perovskites by reducing the R3+ ionic radii, Acta Materialia 2021, 207, 116684

  39. [39]

    Ritter, S

    C. Ritter, S. Sharma, D. T. Adroja, Magnetic structures of the iridium -based double perovskites Pr2NiIrO6 and Nd 2NiIrO6 reinvestigated using neutron diffraction, Physical Review Materials 2022, 6, 084405

  40. [40]

    Ferreira, S

    T. Ferreira, S. Calder, D. S. Parker, et al., Relationship between A -site cation and magnetic structure in 3d-5d-4f double perovskite iridates Ln 2NiIrO6 (Ln=La, Pr, Nd), Physical Review Materials 2021, 5, 064408

  41. [41]

    W. T. Jin, S. H. Chun, J. Kim, et al., Magnetic excitations in the double-perovskite iridates La2MIrO6 (M = Co, Ni, and Zn) mediated by 3d-5d hybridization, Physical Review B 2022, 105, 054419

  42. [42]

    Kresse, J

    G. Kresse, J. Hafner, Ab initio molecular dynamics for open -shell transition metals, Phys Rev B Condens Matter 1993, 48, 13115

  43. [43]

    J. P. Perdew, K. Burke, M. Ernzerhof, Generalized Gradient Approximation Made Simple, Physical Review Letters 1996, 77, 3865. 19 Table of Contents Double perovskite Y2NiIrO6 with half filed 3d eg–5d t2g configuration, exhibits first experimental example of pressure -enhanced magnetic interaction in iridate and iridate -related systems. Its Curie temperatu...